2-(2,5-dimethylphenyl)sulfanyl-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide

Systemtic Name: 2-(2,5-dimethylphenyl)sulfanyl-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide Openeye Name: 2-(2,5-dimethylphenyl)sulfanyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]pyridine-3-carboxamide CAS Name: 2-[(2,5-dimethylphenyl)thio]-N-[[(2R)-2-oxolanyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-(2,5-dimethylphenyl)sulfanyl-N-[[(2R)-oxolan-2-yl]methyl]pyridine-3-carboxamide Traditional Name: 2-[(2,5-dimethylphenyl)thio]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]nicotinamide Formula: C19H22N2O2S MolecularWeight: 342.45518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=C(C=CC=N2)C(=O)NCC3CCCO3

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=C(C=CC=N2)C(=O)NC[C@H]3CCCO3

InChI

InChI=1S/C19H22N2O2S/c1-13-7-8-14(2)17(11-13)24-19-16(6-3-9-20-19)18(22)21-12-15-5-4-10-23-15/h3,6-9,11,15H,4-5,10,12H2,1-2H3,(H,21,22)/t15-/m1/s1